1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-oxidanylidene-1,4-benzoxazin-8-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea

Systemtic Name: 1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-oxidanylidene-1,4-benzoxazin-8-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea Openeye Name: 1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-oxo-1,4-benzoxazin-8-yl]-3-[4-[3-(1-piperidyl)prop-1-ynyl]-1-naphthyl]urea CAS Name: 1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-oxo-1,4-benzoxazin-8-yl]-3-[4-[3-(1-piperidinyl)prop-1-ynyl]-1-naphthalenyl]urea IUPAC Name: 1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-oxo-1,4-benzoxazin-8-yl]-3-[4-(3-piperidin-1-ylprop-1-ynyl)naphthalen-1-yl]urea Traditional Name: 1-[6-tert-butyl-4-(2-dimethylaminoethyl)-3-keto-1,4-benzoxazin-8-yl]-3-[4-(3-piperidinoprop-1-ynyl)-1-naphthyl]urea Formula: C35H43N5O3 MolecularWeight: 581.74762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C(=C1)NC(=O)NC3=CC=C(C4=CC=CC=C43)C#CCN5CCCCC5)OCC(=O)N2CCN(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=C(C(=C1)NC(=O)NC3=CC=C(C4=CC=CC=C43)C#CCN5CCCCC5)OCC(=O)N2CCN(C)C

InChI

InChI=1S/C35H43N5O3/c1-35(2,3)26-22-30(33-31(23-26)40(21-20-38(4)5)32(41)24-43-33)37-34(42)36-29-16-15-25(27-13-7-8-14-28(27)29)12-11-19-39-17-9-6-10-18-39/h7-8,13-16,22-23H,6,9-10,17-21,24H2,1-5H3,(H2,36,37,42)